B7KRB6
  -OEChem-04022109453D

 21 22  0     0  0  0  0  0  0999 V2000
    2.8692   -1.4348    0.0002 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.5766   -1.3975    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   -0.6061    0.7122    0.0003 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.6337   -0.6849    0.0001 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.8386    0.7065    0.0001 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.6859    1.3939    0.0002 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.8192   -0.7937    0.0002 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.8103    1.4227    0.0003 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.8478   -1.3743   -0.0003 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.1796    1.3731   -0.0008 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.0263    0.7361    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.0448   -0.6591   -0.0004 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.6844    2.4795   -0.0001 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.5310   -2.4126   -0.0001 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.8163    2.5098    0.0005 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.8732   -2.4606   -0.0006 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.0941    2.4650   -0.0013 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.7495    1.0845   -0.8899 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.7503    1.0853    0.8882 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.9608    1.2900   -0.0001 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.9932   -1.1885   -0.0008 H   0  0  0  0  0  0  0  0  0  0  0  0
  1  7  2  0  0  0  0
  2  4  1  0  0  0  0
  2  7  1  0  0  0  0
  2 14  1  0  0  0  0
  3  4  1  0  0  0  0
  3  6  1  0  0  0  0
  3  8  2  0  0  0  0
  4  9  2  0  0  0  0
  5  6  2  0  0  0  0
  5  7  1  0  0  0  0
  5 10  1  0  0  0  0
  6 13  1  0  0  0  0
  8 11  1  0  0  0  0
  8 15  1  0  0  0  0
  9 12  1  0  0  0  0
  9 16  1  0  0  0  0
 10 17  1  0  0  0  0
 10 18  1  0  0  0  0
 10 19  1  0  0  0  0
 11 12  2  0  0  0  0
 11 20  1  0  0  0  0
 12 21  1  0  0  0  0
M  END

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